0 B10R1.59 CC(=O)C1=C(C)N=C(Br)S1 MC442176 [0,0,0,0,0,0|1,0,0]=1 1 B10R1.59 CC(=O)C1=C(C)N=C(N)S1 MC442179 [0,0,0,0,0,0|1,0,0]=1 2 B10R1.59 CC(=O)C1=C(C)SC(C)=C1 CS20462 [0,0,0,0,0,0|2,0,0]=2 3 B10R1.59 CC(=O)C1=CC(C)=NN1C CS16943 [0,0,0,0,0,0|2,0,0]=2 4 B10R1.59 CC1=C(C(=O)O)N=C(Br)S1 CS14381 [0,0,0,0,0,0|4,0,0]=4 5 B10R1.59 CC1=C(C(=O)O)N=C(Cl)S1 MC115914 [0,0,0,0,0,0|4,0,0]=4 6 B10R1.59 CC1=C(C(=O)O)NC(Br)=N1 MC105968 [0,0,0,0,0,0|3,0,0]=3 7 B10R1.59 CC1=C(C(=O)O)SC(Br)=C1 MC442190 [0,0,0,0,0,0|3,0,0]=3 8 B10R1.59 CC1=C(C(=O)O)SC(Br)=N1 CS21361 [0,0,0,0,0,0|2,0,0]=2 9 B10R1.59 CC1=C(C(=O)O)SC(N)=N1 CS21256 [0,0,0,0,0,0|2,0,0]=2 10 B10R1.59 CC1=C(C(=O)O)SC(O)=N1 CS12601 [0,0,0,0,0,0|2,0,0]=2 11 B10R1.59 CC1=C(C(N)=O)N=C(Br)S1 MC432526 [0,0,0,0,0,0|4,0,0]=4 12 B10R1.59 CC1=C([N+](=O)[O-])SC(N)=N1 CS21285 [0,0,0,0,0,0|3,0,0]=3 13 B10R1.59 CC1=NC(C(=O)O)=C(Br)O1 MC113285 [0,0,0,0,0,0|4,0,0]=4 14 B10R1.59 CC1=NC(C)=C(C(=O)O)O1 CS13168 [0,0,0,0,0,0|1,1,0]=2 15 B10R1.59 CC1=NC(C)=C(C(=O)O)S1 CS10099 [0,0,0,0,0,0|1,0,0]=1 16 B10R1.59 CC1=NN(C)C=C1C(=O)O CS12794 [0,0,0,0,0,0|3,0,0]=3 17 B10R1.59 CN1N=C(Br)C=C1C(=O)O MC106333 [0,0,0,0,0,0|4,0,0]=4 18 B10R1.59 NC1=NC(Cl)=C(C(=O)O)S1 MC110584 [0,0,0,0,0,0|3,0,0]=3 19 B10R1.59 O=C(O)C1=C(Br)N=C(Br)S1 CS10581 [0,0,0,0,0,0|3,0,0]=3 20 B10R1.59 O=C(O)C1=C(F)C=C(Br)S1 MC430778 [0,0,0,0,0,0|4,0,0]=4 21 B9R1.22 CC1=C(CO)SC(Br)=N1 MC432524 [1,0,0,0,0,0|1,0,2]=4 22 B9R1.22 CC1=CC(C)=C(C=O)N1 CS10535 [1,0,0,0,0,0|2,0,0]=3 23 B9R1.22 CC1=NC(C)=C(C=O)N1 MC427470 [1,0,0,0,0,0|1,0,0]=2 24 B9R1.22 CC1=NN(C)C(C=O)=C1 MC21034 [1,0,0,0,0,0|2,0,0]=3 25 B9R1.22 CC1=NN(C)C=C1C=O CS13371 [1,0,0,0,0,0|2,0,0]=3 26 B9R1.22 CCC1=C(C)N=C(N)S1 CS18463 [1,0,0,0,0,0|1,0,1]=3 27 B9R1.22 NC1=NC(Cl)=C(C=O)S1 CS18473 [1,0,0,0,0,0|2,0,0]=3 28 B9R1.22 O=CC1=C(Cl)N=C(Cl)S1 CS16290 [1,0,0,0,0,0|2,0,0]=3 29 B9R1.22 O=CC1=C(Cl)NC(=O)S1 MC30313 [1,0,0,0,0,0|2,0,1]=4 30 B9R1.35 CC(=O)C1=CC(Br)=NO1 MC431138 [1,0,0,0,0,0|3,0,0]=4 31 B9R1.35 CC(=O)C1=CC(C)=NO1 MC427423 [1,0,0,0,0,0|2,0,0]=3 32 B9R1.35 CC(=O)C1=CC(C)=NS1 MC106270 [1,0,0,0,0,0|2,0,0]=3 33 B9R1.35 CC(=O)C1=CC(N)=NN1 MC103419 [1,0,0,0,0,0|3,0,0]=4 34 B9R1.35 CC(=O)C1=CC=C(Br)O1 CS20429 [1,0,0,0,0,0|2,1,0]=4 35 B9R1.35 CC(=O)C1=CC=C(C)S1 CS20396 [1,0,0,0,0,0|1,0,0]=2 36 B9R1.35 CC(=O)C1=CC=C(Cl)S1 CS21209 [1,0,0,0,0,0|2,0,0]=3 37 B9R1.35 CC(=O)C1=CN=C(Br)S1 CS17877 [1,0,0,0,0,0|1,0,0]=2 38 B9R1.35 CC(=O)C1=CSC(Br)=C1 CS12338 [1,0,0,0,0,0|3,0,0]=4 39 B9R1.35 CC(=O)C1=CSC(N)=N1 CS20386 [1,0,0,0,0,0|3,0,0]=4 40 B9R1.35 CC(=O)C1=NC(C)=CO1 CS16603 [1,0,0,0,0,0|3,0,0]=4 41 B9R1.35 CC(=O)C1=NN(C)C=C1 MC104385 [1,0,0,0,0,0|3,0,0]=4 42 B9R1.35 CC(=O)C1=NOC(C)=C1 CS20434 [1,0,0,0,0,0|3,0,0]=4 43 B9R1.35 CC(C)C1=CN=C(Br)S1 CS14917 [1,0,0,0,0,0|2,0,1]=4 44 B9R1.35 CC1=CC(C(=O)O)=CN1 CS15830 [1,0,0,0,0,0|2,0,1]=4 45 B9R1.35 CC1=CC=C(C(=O)O)O1 CS19440 [1,0,0,0,0,0|2,1,0]=4 46 B9R1.35 CC1=CC=C(C(=O)O)S1 CS23027 [1,0,0,0,0,0|2,0,0]=3 47 B9R1.35 CC1=NC=C(C(=O)O)O1 MC102213 [1,0,0,0,0,0|1,1,0]=3 48 B9R1.35 CC1=NC=C(C(=O)O)S1 CS21657 [1,0,0,0,0,0|1,0,0]=2 49 B9R1.35 CC1=NN=C(C(=O)[O-])O1 CS10429 [1,0,0,0,0,0|2,1,0]=4 50 B9R1.35 CC1=NN=C(C(=O)[O-])S1 CS18089 [1,0,0,0,0,0|2,0,0]=3 51 B9R1.35 CC1=NNC(C(=O)O)=N1 MC431349 [1,0,0,0,0,0|3,0,0]=4 52 B9R1.35 CC1=NOC(C(=O)O)=C1 CS22370 [1,0,0,0,0,0|3,0,0]=4 53 B9R1.35 CC1=NOC(C(=O)[O-])=N1 MC114547 [1,0,0,0,0,0|3,0,0]=4 54 B9R1.35 CC1=NSC(C(=O)O)=C1 MC112963 [1,0,0,0,0,0|3,0,0]=4 55 B9R1.35 CN1C=C(C(=O)O)C=N1 CS19177 [1,0,0,0,0,0|3,0,0]=4 56 B9R1.35 NC(=O)C1=CN=C(Br)S1 MC443285 [1,0,0,0,0,0|2,0,0]=3 57 B9R1.35 NC1=NC=C(C(=O)O)S1 CS18292 [1,0,0,0,0,0|2,0,0]=3 58 B9R1.35 NC1=NC=C([N+](=O)[O-])S1 CS22525 [1,0,0,0,0,0|3,0,0]=4 59 B9R1.35 NC1=NN=C(C(=O)O)S1 CS15409 [1,0,0,0,0,0|3,0,0]=4 60 B9R1.35 O=C(Cl)C1=CC=C(Cl)S1 MC443881 [1,0,0,0,0,0|3,0,0]=4 61 B9R1.35 O=C(O)C1=CC=C(Br)S1 CS17287 [1,0,0,0,0,0|3,0,0]=4 62 B9R1.35 O=C(O)C1=CC=C(Cl)S1 CS17350 [1,0,0,0,0,0|3,0,0]=4 63 B9R1.35 O=C(O)C1=CN=C(Br)O1 CS17421 [1,0,0,0,0,0|2,1,0]=4 64 B9R1.35 O=[N+]([O-])C1=CN=C(Br)S1 CS22532 [1,0,0,0,0,0|3,0,0]=4 65 B9R1.35 O=[N+]([O-])c1cnc(Cl)s1 CS14112 [1,0,0,0,0,0|3,0,0]=4 66 B9R1.41 CC(=O)C1=C(C)N=CS1 MC442175 [1,0,0,0,0,0|0,0,0]=1 67 B9R1.41 CC(=O)C1=C(C)ON=C1 MC430702 [1,0,0,0,0,0|3,0,0]=4 68 B9R1.41 CC(=O)C1=C(I)C=CS1 MC443438 [1,0,0,0,0,0|2,0,0]=3 69 B9R1.41 CC(=O)C1=CNC=C1C MC442581 [1,0,0,0,0,0|3,0,0]=4 70 B9R1.41 CC1=C(C(=O)O)C=CO1 CS21668 [1,0,0,0,0,0|3,0,0]=4 71 B9R1.41 CC1=C(C(=O)O)C=CS1 CS21702 [1,0,0,0,0,0|3,0,0]=4 72 B9R1.41 CC1=C(C(=O)O)N=CO1 CS10431 [1,0,0,0,0,0|3,0,0]=4 73 B9R1.41 CC1=C(C(=O)O)N=CS1 CS17596 [1,0,0,0,0,0|3,0,0]=4 74 B9R1.41 CC1=C(C(=O)O)NC=C1 MC106666 [1,0,0,0,0,0|3,0,0]=4 75 B9R1.41 CC1=C(C(=O)O)OC=N1 CS18905 [1,0,0,0,0,0|1,1,0]=3 76 B9R1.41 CC1=C(C(=O)O)SC=C1 CS23026 [1,0,0,0,0,0|2,0,0]=3 77 B9R1.41 CC1=C(C(=O)O)SC=N1 CS22753 [1,0,0,0,0,0|1,0,0]=2 78 B9R1.41 CC1=C(C(=O)O)SN=C1 MC106261 [1,0,0,0,0,0|3,0,0]=4 79 B9R1.41 CC1=NNC=C1C(=O)O CS18295 [1,0,0,0,0,0|3,0,0]=4 80 B9R1.41 CC1=NOC=C1C(=O)O CS18046 [1,0,0,0,0,0|3,0,0]=4 81 B9R1.41 CN1N=CC=C1C(=O)O CS17278 [1,0,0,0,0,0|3,0,0]=4 82 B9R1.41 O=C(O)C1=C(Br)C=CS1 CS17286 [1,0,0,0,0,0|3,0,0]=4 83 B9R1.41 O=C(O)C1=C(Cl)C=CS1 MC20302 [1,0,0,0,0,0|3,0,0]=4 84 B9R1.41 O=C(O)C1=C(F)C=CS1 CS21775 [1,0,0,0,0,0|3,0,0]=4 85 B9R1.41 O=C(O)C1=C(S)C=CS1 MC116754 [1,0,0,0,0,0|3,0,0]=4 86 B11R1.49 CCC1=C(C(=O)O)SC(C)=N1 CS13358 [0,1,0,0,0,0|1,0,0]=2 87 B11R1.50 COC1=NN(C)C(C(=O)O)=C1 CS15304 [0,1,0,0,0,0|3,0,0]=4 88 B11R1.225 CC1=C(C(=O)CBr)SC(N)=N1 CS17871 [0,1,0,0,0,0|1,0,0]=2 89 B11R1.225 CC1=C(C(=O)CBr)SC(N)=N1 MC100295 [0,1,0,0,0,0|1,0,0]=2 90 B11R1.225 COC(=O)C1=C(C)C=C(N)S1 MC107447 [0,1,0,0,0,0|2,0,0]=3 91 B11R1.225 COC(=O)C1=C(C)N=C(N)S1 CS10113 [0,1,0,0,0,0|1,0,0]=2 92 B11R1.225 COC(=O)C1=C(C)NC(C)=C1 MC441136 [0,1,0,0,0,0|1,0,1]=3 93 B11R1.225 COC(=O)C1=C(Cl)N=C(N)S1 MC110585 [0,1,0,0,0,0|2,0,0]=3 94 B11R1.225 COC(=O)C1=C(F)C=C(Br)S1 MC430779 [0,1,0,0,0,0|3,0,0]=4 95 B11R1.225 COC(=O)C1=C(N)C=C(Br)S1 CS15768 [0,1,0,0,0,0|3,0,0]=4 96 B11R1.225 COC(=O)C1=C(N)C=C(C)S1 CS11620 [0,1,0,0,0,0|2,0,0]=3 97 B11R1.225 COC(=O)C1=C(O)C=C(C)S1 CS12929 [0,1,0,0,0,0|2,0,0]=3 98 B11R1.225 COC(=O)C1=CC(Cl)=NN1C MC444529 [0,1,0,0,0,0|3,0,0]=4 99 B11R1.646 CC1=C(S(N)(=O)=O)SC(Cl)=N1 MC114079 [0,1,0,0,0,0|3,0,0]=4 100 B11R1.673 CC1=NN(C)C(C(=O)O)=C1Br MC431106 [0,1,0,0,0,0|3,0,0]=4 101 B11R1.673 CC1=NN(C)C(C)=C1C(=O)O MC441265 [0,1,0,0,0,0|3,0,0]=4 102 B11R2.66 O=C1NCC2=C1SC(Br)=N2 MC113288 [0,0,0,1,0,0|2,0,0]=3 103 B11R1.74 CC(=O)C1=CC(C)=CC(C)=C1 CS11107 [0,0,0,0,0,1|2,0,0]=3 104 B11R1.74 CC(=O)C1=NC(C)=CC(C)=C1 CS15839 [0,0,0,0,0,1|2,0,0]=3 105 B11R1.74 CC(=O)C1=NC(C)=CC(Cl)=C1 MC427325 [0,0,0,0,0,1|3,0,0]=4 106 B11R1.74 CC1=CC(C(=O)O)=CC(Cl)=N1 CS14042 [0,0,0,0,0,1|3,0,0]=4 107 B11R1.74 CC1=CC(C(=O)O)=NC(C)=C1 MC111081 [0,0,0,0,0,1|3,0,0]=4 108 B11R1.74 CC1=CC(C)=CC(C(=O)Cl)=C1 MC20749 [0,0,0,0,0,1|3,0,0]=4 109 B11R1.74 CC1=CC(C)=CC(C(=O)O)=C1 CS21904 [0,0,0,0,0,1|3,0,0]=4 110 B11R1.74 CC1=CC(C)=CC(C(=O)O)=C1 MC433670 [0,0,0,0,0,1|3,0,0]=4 111 B11R1.74 CC1=CC([N+](=O)[O-])=CC(C)=N1 MC427388 [0,0,0,0,0,1|3,0,0]=4 112 B11R1.74 CC1=NC(N)=CC(C(=O)O)=N1 MC432042 [0,0,0,0,0,1|3,0,0]=4 113 B11R1.166 CC(=O)C1=C(C)C=C(C)N=C1 MC111201 [0,0,0,0,0,1|2,0,0]=3 114 B11R1.166 CC(=O)C1=C(C)C=C(F)C=C1 MC41255 [0,0,0,0,0,1|3,0,0]=4 115 B11R1.166 CC(=O)C1=C(F)C=C(C)C=C1 MC430999 [0,0,0,0,0,1|3,0,0]=4 116 B11R1.166 CC(=O)C1=CC=C(Cl)N=C1Cl CS13204 [0,0,0,0,0,1|3,0,0]=4 117 B11R1.166 CC(=O)C1=CC=C(F)N=C1F CS16677 [0,0,0,0,0,1|3,0,0]=4 118 B11R1.166 CC(=O)C1=CN=C(Cl)N=C1Cl MC103668 [0,0,0,0,0,1|3,0,0]=4 119 B11R1.166 CC(=O)c1ncc(C)cc1C MC111085 [0,0,0,0,0,1|2,0,0]=3 120 B11R1.166 CC1=C(C(=O)O)C=CC(Cl)=N1 CS14724 [0,0,0,0,0,1|3,0,0]=4 121 B11R1.166 CC1=C(C(=O)O)C=CC(F)=N1 CS19398 [0,0,0,0,0,1|3,0,0]=4 122 B11R1.166 CC1=C(C(N)=O)C=CC(Cl)=N1 MC106129 [0,0,0,0,0,1|3,0,0]=4 123 B11R1.166 CC1=CC(C)=C(C(=O)Cl)C=C1 MC40470 [0,0,0,0,0,1|3,0,0]=4 124 B11R1.166 CC1=CC(C)=C(C(=O)O)C=C1 CS21071 [0,0,0,0,0,1|3,0,0]=4 125 B11R1.166 CC1=CC(C)=NC=C1C(=O)O CS22514 [0,0,0,0,0,1|3,0,0]=4 126 B11R1.166 CC1=CC=C([N+](=O)[O-])C(C)=N1 MC10391 [0,0,0,0,0,1|3,0,0]=4 127 B11R1.166 CC1=CN=C(C(=O)O)C(C)=N1 CS15178 [0,0,0,0,0,1|2,0,0]=3 128 B11R1.166 CC1=NC(Cl)=C(C(=O)O)C=C1 CS20205 [0,0,0,0,0,1|3,0,0]=4 129 B11R1.166 CC1=NC(Cl)=CC=C1C(=O)Cl MC106019 [0,0,0,0,0,1|3,0,0]=4 130 B11R1.166 CC1=NC=C(C(=O)O)C(Cl)=N1 MC443338 [0,0,0,0,0,1|3,0,0]=4 131 B11R1.167 CC(=O)C1=C(C)C=CC(F)=C1 MC41256 [0,0,0,0,0,1|3,0,0]=4 132 B11R1.167 CC(=O)C1=C(F)C=CC(C)=C1 MC41254 [0,0,0,0,0,1|3,0,0]=4 133 B11R1.167 CC(=O)C1=CC(Br)=CN=C1F MC425594 [0,0,0,0,0,1|3,0,0]=4 134 B11R1.167 CC(=O)C1=NC(C)=CC=C1C MC111076 [0,0,0,0,0,1|2,0,0]=3 135 B11R1.167 CC(=O)C1=NC(Cl)=NC=C1C CS15957 [0,0,0,0,0,1|2,0,0]=3 136 B11R1.167 CC1=C(C(=O)O)C=C(Br)C=N1 CS15972 [0,0,0,0,0,1|3,0,0]=4 137 B11R1.167 CC1=CC(C(=O)O)=C(C)C=C1 CS21075 [0,0,0,0,0,1|3,0,0]=4 138 B11R1.167 CC1=CC(C(=O)O)=C(Cl)N=C1 CS17254 [0,0,0,0,0,1|3,0,0]=4 139 B11R1.167 CC1=CC(C(=O)O)=C(I)N=C1 MC429858 [0,0,0,0,0,1|3,0,0]=4 140 B11R1.167 CC1=CC(C(=O)O)=C(N)N=C1 MC112964 [0,0,0,0,0,1|3,0,0]=4 141 B11R1.167 CC1=CC=C(C)C(C(=O)O)=N1 MC111078 [0,0,0,0,0,1|3,0,0]=4 142 B11R1.167 CC1=CN=C(C)C(C(=O)O)=N1 MC105730 [0,0,0,0,0,1|2,0,0]=3 143 B11R1.167 CC1=CN=C(Cl)N=C1C(=O)O MC115904 [0,0,0,0,0,1|3,0,0]=4 144 B11R1.167 CC1=NC=C(Br)C(C(=O)O)=C1 MC432147 [0,0,0,0,0,1|3,0,0]=4 145 B11R1.167 CC1=NC=C(Br)C(C(=O)O)=N1 CS19714 [0,0,0,0,0,1|3,0,0]=4 146 B11R1.167 CC1=NC=C(Cl)C(C(=O)O)=N1 MC444393 [0,0,0,0,0,1|3,0,0]=4 147 B8R1.1 CC1=CC(C=O)=CS1 MC443650 [2,0,0,0,0,0|2,0,0]=4 148 B8R1.1 CC1=CC=C(C=O)N1 CS10436 [2,0,0,0,0,0|2,0,0]=4 149 B8R1.1 CC1=CC=C(C=O)S1 MC20284 [2,0,0,0,0,0|1,0,0]=3 150 B8R1.1 CC1=CN=C(C=O)S1 MC425517 [2,0,0,0,0,0|2,0,0]=4 151 B8R1.1 CC1=NC=C(C=O)S1 MC21171 [2,0,0,0,0,0|0,0,0]=2 152 B8R1.1 CC1=NSC(C=O)=C1 MC116147 [2,0,0,0,0,0|2,0,0]=4 153 B8R1.1 CN1C=C(C=O)C=N1 CS18189 [2,0,0,0,0,0|2,0,0]=4 154 B8R1.1 COC1=NN=C(C)S1 MC107310 [2,0,0,0,0,0|2,0,0]=4 155 B8R1.1 NC1=NC=C(C=O)S1 CS21279 [2,0,0,0,0,0|1,0,0]=3 156 B8R1.1 O=CC1=CC=C(Br)S1 CS18323 [2,0,0,0,0,0|2,0,0]=4 157 B8R1.11 CC1=NNC=C1C=O CS22355 [2,0,0,0,0,0|2,0,0]=4 158 B8R1.11 CN1N=CC=C1C=O CS18205 [2,0,0,0,0,0|2,0,0]=4 159 B8R1.11 CN1N=CN=C1C=O MC106469 [2,0,0,0,0,0|2,0,0]=4 160 B8R1.11 NC1=C(C=O)SC=C1 CS14842 [2,0,0,0,0,0|2,0,0]=4 161 B8R1.11 O=CC1=C(Br)C=CS1 CS17288 [2,0,0,0,0,0|2,0,0]=4 162 B8R1.11 O=CC1=C(Br)N=CS1 CS15329 [2,0,0,0,0,0|1,0,0]=3 163 B8R1.11 O=CC1=C(Cl)N=CS1 CS22797 [2,0,0,0,0,0|1,0,0]=3 164 B8R1.11 O=CC1=C(F)C=CS1 MC429390 [2,0,0,0,0,0|2,0,0]=4 165 B8R1.18 CC1=C(Br)N=C(Br)S1 MC442181 [2,0,0,0,0,0|2,0,0]=4 166 B8R1.18 CC1=C(Br)SC(N)=N1 CS15953 [2,0,0,0,0,0|2,0,0]=4 167 B8R1.18 CC1=C(Br)SC(N)=N1 CS21269 [2,0,0,0,0,0|2,0,0]=4 168 B8R1.18 CC1=C(C)SC(Br)=N1 CS13229 [2,0,0,0,0,0|1,0,0]=3 169 B8R1.18 CC1=C(C)SC(N)=N1 CS21234 [2,0,0,0,0,0|1,0,0]=3 170 B8R1.18 CC1=C(Cl)N=C(Cl)S1 CS16846 [2,0,0,0,0,0|2,0,0]=4 171 B8R1.18 CC1=CC(C)=NN1C CS19810 [2,0,0,0,0,0|2,0,0]=4 172 B8R1.18 CC1=CC(I)=C(C)S1 MC425075 [2,0,0,0,0,0|2,0,0]=4 173 B8R1.18 CC1=NN(C)C(=O)C1 CS17716 [2,0,0,0,0,0|2,0,0]=4 174 B8R1.7 CC(=O)C1=CC=CO1 CS18634 [2,0,0,0,0,0|1,1,0]=4 175 B8R1.7 CC(=O)C1=CC=CS1 CS19387 [2,0,0,0,0,0|1,0,0]=3 176 B8R1.7 CC(=O)C1=CC=NO1 CS15344 [2,0,0,0,0,0|2,0,0]=4 177 B8R1.7 CC(=O)C1=CN=NS1 MC106686 [2,0,0,0,0,0|1,0,0]=3 178 B8R1.7 CC(=O)C1=CNC=N1 CS20378 [2,0,0,0,0,0|1,0,1]=4 179 B8R1.7 CC(=O)C1=CSC=C1 CS18739 [2,0,0,0,0,0|2,0,0]=4 180 B8R1.7 CC(=O)C1=CSC=N1 CS13244 [2,0,0,0,0,0|2,0,0]=4 181 B8R1.7 CC(=O)C1=NC=CS1 CS22755 [2,0,0,0,0,0|2,0,0]=4 182 B8R1.7 CC(=O)N1C=CN=C1 MC428372 [2,0,0,0,0,0|2,0,0]=4 183 B8R1.7 CC(O)C1=CN=CS1 MC116219 [2,0,0,0,0,0|0,0,2]=4 184 B8R1.7 NC(=S)C1=CN=CS1 MC113938 [2,0,0,0,0,0|1,1,0]=4 185 B8R1.7 O=C(O)C1=CC=CS1 MC41710 [2,0,0,0,0,0|2,0,0]=4 186 B8R1.7 O=C(O)C1=CN=CS1 CS15551 [2,0,0,0,0,0|1,0,0]=3 187 B10R1.256 CC1=NN(C)C(Cl)=C1C=O CS10314 [1,1,0,0,0,0|2,0,0]=4 188 B10R1.14 CC1=NOC(C(=O)CBr)=C1 CS11313 [1,1,0,0,0,0|2,0,0]=4 189 B10R1.14 CCC(=O)C1=CC=C(C)O1 MC41697 [1,1,0,0,0,0|1,1,0]=4 190 B10R1.14 COC(=O)C1=CC=C(Br)S1 CS10309 [1,1,0,0,0,0|2,0,0]=4 191 B10R1.14 COC(=O)C1=CC=C(Cl)S1 CS17193 [1,1,0,0,0,0|2,0,0]=4 192 B10R1.14 COC(=O)C1=CN=C(Br)S1 CS17469 [1,1,0,0,0,0|1,0,0]=3 193 B10R1.14 COC(=O)C1=CN=C(Cl)S1 CS15219 [1,1,0,0,0,0|1,0,0]=3 194 B10R1.14 COC(=O)C1=CN=C(N)S1 CS17987 [1,1,0,0,0,0|1,0,0]=3 195 B10R1.14 COC(=O)C1=COC(C)=N1 CS19368 [1,1,0,0,0,0|2,0,0]=4 196 B10R1.14 COC(=O)C1=NC(C)=NS1 MC42244 [1,1,0,0,0,0|2,0,0]=4 197 B10R1.14 COC(=O)C1=NC=C(C)S1 MC20969 [1,1,0,0,0,0|2,0,0]=4 198 B10R1.14 COC(=O)C1=NN(C)N=C1 MC113395 [1,1,0,0,0,0|2,0,0]=4 199 B10R1.14 COC(=O)C1=NN=C(C)O1 CS15328 [1,1,0,0,0,0|1,1,0]=4 200 B10R1.58 CC(=O)C1=CC(C)=C(Br)S1 CS16987 [1,1,0,0,0,0|2,0,0]=4 201 B10R1.58 CC1=C(Br)C=C(C(=O)O)S1 CS15301 [1,1,0,0,0,0|2,0,0]=4 202 B10R1.149 COC(=O)C1=C(Br)C=CS1 CS19022 [1,1,0,0,0,0|2,0,0]=4 203 B10R1.149 COC(=O)C1=C(C)C=CS1 MC20532 [1,1,0,0,0,0|1,0,0]=3 204 B10R1.149 COC(=O)C1=C(C)N=CS1 CS10100 [1,1,0,0,0,0|0,0,0]=2 205 B10R1.149 COC(=O)C1=C(C)OC=N1 CS12233 [1,1,0,0,0,0|2,0,0]=4 206 B10R1.149 COC(=O)C1=C(C)SC=C1 CS12807 [1,1,0,0,0,0|2,0,0]=4 207 B10R1.149 COC(=O)C1=C(F)C=CS1 MC430932 [1,1,0,0,0,0|2,0,0]=4 208 B10R1.149 COC(=O)C1=C(I)C=CS1 MC431931 [1,1,0,0,0,0|2,0,0]=4 209 B10R1.149 COC(=O)C1=C(N)C=CS1 CS18173 [1,1,0,0,0,0|2,0,0]=4 210 B10R1.149 COC(=O)C1=CC=NN1C CS16991 [1,1,0,0,0,0|2,0,0]=4 211 B10R1.149 COC(=O)C1=CNN=C1C CS14906 [1,1,0,0,0,0|2,0,0]=4 212 B12R1.358 COC(=O)C1=CC(Cl)=NC(C)=C1 CS14289 [0,1,0,0,0,1|2,0,0]=4 213 B12R1.358 COC(=O)C1=NC(C)=CC(C)=C1 MC432026 [0,1,0,0,0,1|2,0,0]=4 214 B12R1.511 CC(=O)C1=C(O)C(C)=CC(C)=C1 MC107735 [0,1,0,0,0,1|2,0,0]=4 215 B12R1.452 CSC1=NC=C(C(C)=O)C(N)=N1 MC444076 [0,1,0,0,0,1|2,0,0]=4 216 B12R1.1000 CC1=CC(C)=NC(C)=C1C(=O)O MC442149 [0,1,0,0,0,1|2,0,0]=4 217 B12R1.1703 COC(=O)C1=C(Br)N=C(C)C=C1 MC443365 [0,1,0,0,0,1|2,0,0]=4 218 B12R1.1703 COC(=O)C1=C(C)N=C(N)C=C1 CS16936 [0,1,0,0,0,1|2,0,0]=4 219 B12R1.1703 COC(=O)C1=CN=C(C)N=C1Cl MC443339 [0,1,0,0,0,1|2,0,0]=4 220 B12R1.1703 COC(=O)C1=CN=C(Cl)N=C1C MC432032 [0,1,0,0,0,1|2,0,0]=4 221 B12R1.1703 COC(=O)C1=CN=C(N)N=C1C MC442170 [0,1,0,0,0,1|2,0,0]=4 222 B12R1.1703 COC(=O)C1=NC=C(C)N=C1Cl MC116442 [0,1,0,0,0,1|2,0,0]=4 223 B12R1.46 COC1=CN=C(C)N=C1C(=O)O MC105061 [0,1,0,0,0,1|2,0,0]=4 224 B12R1.354 COC(=O)C1=C(C)N=CC(Br)=C1 CS16882 [0,1,0,0,0,1|2,0,0]=4 225 B12R1.354 COC(=O)C1=C(O)N=CC(C)=C1 MC432223 [0,1,0,0,0,1|2,0,0]=4 226 B12R1.354 COC(=O)C1=NC(C)=CN=C1C CS17622 [0,1,0,0,0,1|1,0,0]=3 227 B12R1.1926 CCC1=C(C(=O)OC)NC(C)=N1 MC31042 [0,2,0,0,0,0|1,0,0]=3 228 B12R1.1926 COC(=O)C1=C(OC)C=C(Br)S1 CS17189 [0,2,0,0,0,0|2,0,0]=4 229 B12R1.608 COC(=O)C1=C(O)C=C(SC)S1 MC113826 [0,2,0,0,0,0|2,0,0]=4 230 B12R1.313 CCOC(=O)C1=C(C)C=C(C)N1 CS10913 [0,2,0,0,0,0|2,0,0]=4 231 B12R1.313 CCOC(=O)C1=C(C)N=C(Br)S1 CS11333 [0,2,0,0,0,0|1,0,0]=3 232 B12R1.313 CCOC(=O)C1=C(C)N=C(N)O1 MC100062 [0,2,0,0,0,0|1,1,0]=4 233 B12R1.313 CCOC(=O)C1=C(C)N=C(N)S1 CS19589 [0,2,0,0,0,0|1,0,0]=3 234 B12R1.313 CCOC(=O)C1=C(C)NC(C)=C1 MC441139 [0,2,0,0,0,0|1,0,1]=4 235 B12R1.313 CCOC(=O)C1=C(O)N=C(C)S1 CS18153 [0,2,0,0,0,0|1,0,0]=3 236 B12R1.313 CCOC(=O)C1SC(C)=NC1=O MC431891 [0,2,0,0,0,0|1,0,1]=4 237 B12R1.362 COC(=O)C1=C(O)C(C)=C(C)S1 MC105761 [0,2,0,0,0,0|2,0,0]=4 238 B12R1.3443 COC(=O)C1=C(C)C(C)=NN1C CS12703 [0,2,0,0,0,0|2,0,0]=4 239 B12R1.3443 COC(=O)C1=C(C)NC(C)=C1Br MC105815 [0,2,0,0,0,0|1,0,1]=4 240 B12R1.3443 COC(=O)C1=C(C)NC(C)=C1C MC441137 [0,2,0,0,0,0|1,0,1]=4 241 B10R1.61 CC(=O)C1=CN=CN=C1C CS17792 [0,0,1,1,0,0|2,0,0]=4 242 B10R1.113 CC(=O)C1=CC(C)=NC=C1 CS18206 [0,0,1,1,0,0|1,0,1]=4 243 B10R2.2 NC1=NC2=C(CCC2)S1 MC442185 [1,0,0,1,0,0|1,0,1]=4 244 B10R2.32 O=C1CCC2=C1SC=C2 MC429082 [1,0,0,1,0,0|1,0,0]=3 245 B12R2.612 CC1=CC=C2C(=O)CCC2=C1 MC446693 [0,0,0,1,0,1|2,0,0]=4 246 B12R2.132 CC1=CC=C2CCC(=O)C2=C1 MC446759 [0,0,0,1,0,1|2,0,0]=4 247 B12R2.132 CC1=NC=C2OCC(=O)C2=C1 MC102724 [0,0,0,1,0,1|2,0,0]=4 248 B12R2.202 CN1C=C2C(=O)CCCC2=N1 CS17030 [0,1,0,1,0,0|2,0,0]=4 249 B12R2.202 NC1=NC2=C(S1)C(=O)CCC2 CS12170 [0,1,0,1,0,0|1,0,0]=3 250 B12R2.202 O=C1NCCC2=C1SC(Br)=C2 MC100537 [0,1,0,1,0,0|2,0,0]=4 251 B12R2.202 O=C1NCCC2=C1SC(Br)=N2 MC113843 [0,1,0,1,0,0|1,0,0]=3 252 B10R1.8 CC1=CC(C)=CC(C=O)=C1 CS21068 [1,0,0,0,0,1|2,0,0]=4 253 B10R1.8 CC1=CC(C=O)=CC(C)=N1 MC443203 [1,0,0,0,0,1|1,0,0]=3 254 B10R1.8 CC1=NC(Cl)=CC(C=O)=N1 MC33388 [1,0,0,0,0,1|2,0,0]=4 255 B10R1.25 CC1=C(C=O)C=CC(Br)=N1 MC443390 [1,0,0,0,0,1|2,0,0]=4 256 B10R1.25 CC1=C(C=O)C=CC(N)=N1 MC430302 [1,0,0,0,0,1|2,0,0]=4 257 B10R1.25 CC1=CC(C)=C(C=O)C=C1 CS21114 [1,0,0,0,0,1|2,0,0]=4 258 B10R1.25 CC1=CC=C(C=O)C(Br)=N1 MC111591 [1,0,0,0,0,1|2,0,0]=4 259 B10R1.25 COC1=CN=C(C)N=C1C CS16889 [1,0,0,0,0,1|2,0,0]=4 260 B10R1.25 COC1=NC=C(C)N=C1C CS15176 [1,0,0,0,0,1|2,0,0]=4 261 B10R1.13 CC(=O)C1=CC=C(Br)N=C1 CS17999 [1,0,0,0,0,1|2,0,0]=4 262 B10R1.13 CC(=O)C1=CC=C(C)C=C1 CS13558 [1,0,0,0,0,1|2,0,0]=4 263 B10R1.13 CC(=O)C1=CC=C(C)N=N1 MC112296 [1,0,0,0,0,1|2,0,0]=4 264 B10R1.13 CC(=O)C1=CC=C(Cl)N=C1 CS19687 [1,0,0,0,0,1|2,0,0]=4 265 B10R1.13 CC(=O)C1=CC=C(F)N=C1 CS16982 [1,0,0,0,0,1|2,0,0]=4 266 B10R1.13 CC(=O)C1=CC=C(O)N=C1 CS12692 [1,0,0,0,0,1|2,0,0]=4 267 B10R1.13 CC(=O)C1=CN=C(C)C=C1 MC428167 [1,0,0,0,0,1|1,0,0]=3 268 B10R1.13 CC(=O)C1=CN=C(C)N=C1 MC444074 [1,0,0,0,0,1|1,0,0]=3 269 B10R1.13 CC(=O)C1=CN=C(N)N=C1 CS17494 [1,0,0,0,0,1|2,0,0]=4 270 B10R1.13 CC(=O)C1=NC=C(C)C=C1 MC443649 [1,0,0,0,0,1|2,0,0]=4 271 B10R1.13 CC(=O)C1=NC=C(C)N=C1 MC444078 [1,0,0,0,0,1|1,0,0]=3 272 B10R1.13 CC(=O)C1=NC=C(Cl)N=C1 CS14519 [1,0,0,0,0,1|2,0,0]=4 273 B10R1.13 CC1=CN=C(C(=O)O)C=N1 CS19370 [1,0,0,0,0,1|2,0,0]=4 274 B10R1.13 CC1=NC=C(C(=O)O)C=C1 CS20324 [1,0,0,0,0,1|2,0,0]=4 275 B10R1.13 CC1=NC=C(C(=O)O)C=N1 CS21698 [1,0,0,0,0,1|2,0,0]=4 276 B10R1.13 CC1=NC=C(C(N)=O)C=C1 CS18427 [1,0,0,0,0,1|2,0,0]=4